Structure of PDB 1roe Chain A Binding Site BS01

Receptor Information
>1roe Chain A (length=97) Species: 32046 (Synechococcus elongatus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ATYKVTLVRPDGSETTIDVPEDEYILDVAEEQGLDLPFSCRAGACSTCAG
KLLEGEVDQSDQSFLDDDQIEKGFVLTCVAYPRSDCKILTNQEEELY
Ligand information
Ligand IDFES
InChIInChI=1S/2Fe.2S
InChIKeyNIXDOXVAJZFRNF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04[Fe]1S[Fe]S1
CACTVS 3.341
OpenEye OEToolkits 1.5.0		S1[Fe]S[Fe]1
FormulaFe2 S2
NameFE2/S2 (INORGANIC) CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain1roe Chain A Residue 98 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1roe Structure of Synechococcus elongatus [Fe2S2] ferredoxin in solution.
ResolutionN/A
Binding residue
(original residue number in PDB)		C40 R41 G43 C45 C48 V75 C78
Binding residue
(residue number reindexed from 1)		C40 R41 G43 C45 C48 V75 C78
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005515 protein binding
GO:0009055 electron transfer activity
GO:0046872 metal ion binding
GO:0051536 iron-sulfur cluster binding
GO:0051537 2 iron, 2 sulfur cluster binding
Biological Process
GO:0022900 electron transport chain

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Molecular Function
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Biological Process
External links
PDB RCSB:1roe, PDBe:1roe, PDBj:1roe
PDBsum1roe
PubMed8841126
UniProtP0A3C9|FER_THEVB Ferredoxin-1 (Gene Name=petF1)

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